methyl(prop-2-ynyl)tin

C4H6Sn — CID 174450522

IUPACmethyl(prop-2-ynyl)tin
SMILESC#CC[Sn]C
InChIInChI=1S/C3H3.CH3.Sn/c1-3-2;;/h1H,2H2;1H3;
InChIKeyABIWBZIMXQMWTM-UHFFFAOYSA-N
MW172.80 g/mol
LogP0.79
Rot. Bonds1

About methyl(prop-2-ynyl)tin

methyl(prop-2-ynyl)tin (PubChem CID 174450522) has the molecular formula C4H6Sn and a molecular weight of 172.80 g/mol. Its IUPAC name is methyl(prop-2-ynyl)tin.

Molecular Properties

Compound Namemethyl(prop-2-ynyl)tin
PubChem CID174450522
Molecular FormulaC4H6Sn
Molecular Weight172.80 g/mol
Exact Mass173.95
IUPAC Namemethyl(prop-2-ynyl)tin
SMILESC#CC[Sn]C
InChIInChI=1S/C3H3.CH3.Sn/c1-3-2;;/h1H,2H2;1H3;
InChIKeyABIWBZIMXQMWTM-UHFFFAOYSA-N
XLogP0.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.80
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

but-1-yne;hydrochloride
CID 172711742
but-1-yne;ruthenium;hydrochloride
CID 160987878
butane;but-1-yne;propane
CID 155749259
3-bis(prop-2-ynyl)phosphorylprop-1-yne
CID 87156145
3-(111C)methoxyprop-1-yne
CID 58004452
but-1-yne;bis(but-2-yne);methane
CID 159335852
but-1-yne;hexane
CID 18785170
CID 173487750
CID 173487750
4-methylhepta-1,5-diyne
CID 91178010
N-[[but-3-ynoyl(methyl)amino]methyl]-N-methylbut-3-ynamide
CID 170404033
CID 153412354
CID 153412354
2,3-dimethyl-N-prop-2-ynylbutan-1-amine
CID 64568255

Frequently Asked Questions

What is the IUPAC name of methyl(prop-2-ynyl)tin?
The IUPAC name of methyl(prop-2-ynyl)tin (CID 174450522) is methyl(prop-2-ynyl)tin.
What is the SMILES notation for methyl(prop-2-ynyl)tin?
The canonical SMILES for methyl(prop-2-ynyl)tin is C#CC[Sn]C.
What is the InChIKey of methyl(prop-2-ynyl)tin?
The InChIKey is ABIWBZIMXQMWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3.CH3.Sn/c1-3-2;;/h1H,2H2;1H3;.
What are the key properties of methyl(prop-2-ynyl)tin?
methyl(prop-2-ynyl)tin has a molecular weight of 172.80 g/mol, XLogP of 0.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(prop-2-ynyl)tin is sourced from PubChem (CID 174450522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).